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With the proliferation of Graph Neural Network (GNN) methods stemming from contrastive learning, unsupervised node representation learning for graph data is rapidly gaining traction across various fields, from biology to molecular dynamics,…

机器学习 · 计算机科学 2024-08-01 Jihee You , So Won Jeong , Claire Donnat

Overfitting is a well-known issue extending even to state-of-the-art (SOTA) Machine Learning (ML) models, resulting in reduced generalization, and a significant train-test performance gap. Mitigation measures include a combination of…

机器学习 · 计算机科学 2025-05-29 Shreyas Gururaj , Lars Grüne , Wojciech Samek , Sebastian Lapuschkin , Leander Weber

Uncertainty estimation in Neural Networks (NNs) is vital in improving reliability and confidence in predictions, particularly in safety-critical applications. Bayesian Neural Networks (BayNNs) with Dropout as an approximation offer a…

This paper investigates the feasibility of using Graph Neural Networks (GNNs) for classical motion planning problems. We propose guiding both continuous and discrete planning algorithms using GNNs' ability to robustly encode the topology of…

机器人学 · 计算机科学 2020-12-15 Arbaaz Khan , Alejandro Ribeiro , Vijay Kumar , Anthony G. Francis

Graph Neural Networks (GNNs) have been extensively used for mining graph-structured data with impressive performance. However, because these traditional GNNs do not distinguish among various downstream tasks, embeddings embedded by them are…

机器学习 · 计算机科学 2024-09-20 Jianpeng Chen , Yujing Wang , Ming Zeng , Zongyi Xiang , Bitan Hou , Yunhai Tong , Ole J. Mengshoel , Yazhou Ren

The recent success of Deep Neural Networks (DNNs) has drastically improved the state of the art for many application domains. While achieving high accuracy performance, deploying state-of-the-art DNNs is a challenge since they typically…

神经与进化计算 · 计算机科学 2018-01-24 Hokchhay Tann , Soheil Hashemi , Sherief Reda

Dropout as a common regularizer to prevent overfitting in deep neural networks has been less effective in convolutional layers than in fully connected layers. This is because Dropout drops features randomly, without considering local…

机器学习 · 计算机科学 2025-06-05 Liyan Chen , Philippos Mordohai , Sergul Aydore

Using a large number of parameters , deep neural networks have achieved remarkable performance on computer vison and natural language processing tasks. However the networks usually suffer from overfitting by using too much parameters.…

计算机视觉与模式识别 · 计算机科学 2018-10-24 Zhengsu Chen Jianwei Niu Qi Tian

Graph representation learning is gaining popularity in a wide range of applications, such as social networks analysis, computational biology, and recommender systems. However, different with positive results from many academic studies,…

机器学习 · 统计学 2020-08-21 Young-Jin Park , Kyuyong Shin , Kyung-Min Kim

Deep neural networks possess strong representational capacity yet remain vulnerable to overfitting, primarily because neurons tend to co-adapt in ways that, while capturing complex and fine-grained feature interactions, also reinforce…

机器学习 · 计算机科学 2025-12-16 Gelesh G Omathil , Sreeja CS

We present a novel set of rigorous and computationally efficient topology-based complexity notions that exhibit a strong correlation with the generalization gap in modern deep neural networks (DNNs). DNNs show remarkable generalization…

机器学习 · 计算机科学 2024-12-17 Rayna Andreeva , Benjamin Dupuis , Rik Sarkar , Tolga Birdal , Umut Şimşekli

Sampling methods (e.g., node-wise, layer-wise, or subgraph) has become an indispensable strategy to speed up training large-scale Graph Neural Networks (GNNs). However, existing sampling methods are mostly based on the graph structural…

机器学习 · 计算机科学 2021-09-07 Weilin Cong , Rana Forsati , Mahmut Kandemir , Mehrdad Mahdavi

We study the problem of semi-supervised learning on graphs, for which graph neural networks (GNNs) have been extensively explored. However, most existing GNNs inherently suffer from the limitations of over-smoothing, non-robustness, and…

机器学习 · 计算机科学 2021-09-22 Wenzheng Feng , Jie Zhang , Yuxiao Dong , Yu Han , Huanbo Luan , Qian Xu , Qiang Yang , Evgeny Kharlamov , Jie Tang

Graphs play an important role in many applications. Recently, Graph Neural Networks (GNNs) have achieved promising results in graph analysis tasks. Some state-of-the-art GNN models have been proposed, e.g., Graph Convolutional Networks…

机器学习 · 计算机科学 2021-09-29 Yaoman Li , Irwin King

Deep neural networks are typically trained by uniformly sampling large datasets across epochs, despite evidence that not all samples contribute equally throughout learning. Recent work shows that progressively reducing the amount of…

机器学习 · 计算机科学 2026-04-15 Amar Gahir , Varshil Patel , Shreyank N Gowda

Graph Neural Networks (GNNs) have shown to be powerful tools for graph analytics. The key idea is to recursively propagate and aggregate information along edges of the given graph. Despite their success, however, the existing GNNs are…

机器学习 · 计算机科学 2020-11-16 Dongsheng Luo , Wei Cheng , Wenchao Yu , Bo Zong , Jingchao Ni , Haifeng Chen , Xiang Zhang

In this work, we introduce Y-Drop, a regularization method that biases the dropout algorithm towards dropping more important neurons with higher probability. The backbone of our approach is neuron conductance, an interpretable measure of…

机器学习 · 计算机科学 2024-09-17 Efthymios Georgiou , Georgios Paraskevopoulos , Alexandros Potamianos

It is known that the current graph neural networks (GNNs) are difficult to make themselves deep due to the problem known as over-smoothing. Multi-scale GNNs are a promising approach for mitigating the over-smoothing problem. However, there…

机器学习 · 计算机科学 2021-01-07 Kenta Oono , Taiji Suzuki

Graph Neural Networks (GNNs) have achieved promising performance on a wide range of graph-based tasks. Despite their success, one severe limitation of GNNs is the over-smoothing issue (indistinguishable representations of nodes in different…

机器学习 · 计算机科学 2019-11-19 Deli Chen , Yankai Lin , Wei Li , Peng Li , Jie Zhou , Xu Sun

We propose a Graph Neural Network with greater expressive power than commonly used GNNs - not constrained to only differentiate between graphs that Weisfeiler-Lehman test recognizes to be non-isomorphic. We use a graph attention network…

机器学习 · 计算机科学 2020-04-14 Stanisław Purgał